SCHEMBL25828008

SCHEMBL25828008

Cc1cc(C)c(C)c(-c2c3cccnc3nc[n+]2C)c1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CCR1 P32246 1/20 0.35
CCR8 P51685 1/20 0.35
IDO1 P14902 1/20 0.34
NPC1 O15118 1/20 0.33
HSP90AA1 P07900 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
ALDH1A1 P00352 2/20 0.32
MAPT P10636 2/20 0.32
LMNA P02545 1/20 0.32
HPGD P15428 1/20 0.32
MAPK1 P28482 1/20 0.32
HTT P42858 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
NUDT1 P36639 1/20 0.32
SLC40A1 Q9NP59 1/20 0.31
MEN1 O00255 1/20 0.30
CRHBP P24387 1/20 0.30
KMT2A Q03164 1/20 0.30
CRHR2 Q13324 1/20 0.30
NPSR1 Q6W5P4 1/20 0.30

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL25518830 0.83 PSMB5 (0.36) L3MBTL1MAPTLMNAMAPK1MEN1
SCHEMBL25518861 0.79 HTR1A (0.37) ALDH1A1MAPTLMNASMN1; SMN2MEN1
SCHEMBL25518935 0.76 NSD3 (0.33)
SCHEMBL25518862 0.74 LMNA (0.34) LMNA
SCHEMBL26813177 0.74 NQO2 (0.33) NPC1
SCHEMBL26813172 0.72 KDM4E (0.30) ALDH1A1SMN1; SMN2KMT2A
SCHEMBL25518863 0.71 KDM4E (0.31) SMN1; SMN2
SCHEMBL25823193 0.70 MAPT (0.45) CCR1CCR8NPC1HSP90AA1L3MBTL1
SCHEMBL25519043 0.70 HTR2C (0.33)
SCHEMBL25518415 0.69 CYP2A6 (0.43) ALDH1A1MAPTLMNAHPGDHTT

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230320210-A1 HOST MATERIALS FOR ELECTROLUMINESCENT DEVICES UNIVERSAL DISPLAY CORPORATION (US) 2023-10-05 US disclosed
US-11700766-B2 Host materials for electroluminescent devices UNIVERSAL DISPLAY CORPORATION (US) 2023-07-11 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-11700766-B2 Host materials for electroluminescent devices OR10J3, OCIAD2, MCM4 CCR1 1190/4885CCR8 1006/4885IDO1 2094/4885
US-20230320210-A1 HOST MATERIALS FOR ELECTROLUMINESCENT DEVICES OR10J3, OCIAD2, MCM4 CCR1 1190/4885CCR8 1006/4885IDO1 2094/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.